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Record W3107554168 · doi:10.1088/2053-1583/abf715

Dispersing and semi-flat bands in the wide band gap two-dimensional semiconductor bilayer silicon oxide

2021· article· en· W3107554168 on OpenAlexfundno aff
Geoffroy Kremer, Juan Camilo Alvarez Quiceno, Thomas Pierron, César González, M. Sicot, B. Kierren, Luc Moreau, Julien Rault, Patrick Le Fèvre, F. Bertran, Yannick J. Dappe, Johann Coraux, Pascal Pochet, Y. Fagot‐Révurat

Bibliographic record

Venue2D Materials · 2021
Typearticle
Languageen
FieldMaterials Science
TopicGraphene research and applications
Canadian institutionsnot available
FundersGrand Équipement National De Calcul IntensifComunidad de MadridSchweizerischer Nationalfonds zur Förderung der Wissenschaftlichen ForschungAgence Nationale de la RechercheOttawa Hospital Research InstituteNational Science Foundation
KeywordsBand gapSemiconductorMaterials scienceBilayerSiliconDensity functional theoryHeterojunctionBilayer grapheneElectronic band structureElectronic structurevan der Waals forceOptoelectronicsDirect and indirect band gapsCondensed matter physicsMolecular physicsGrapheneNanotechnologyChemistryComputational chemistryPhysicsMolecule

Abstract

fetched live from OpenAlex

Abstract Epitaxial bilayer silicon oxide is a transferable two-dimensional material predicted to be a wide band gap semiconductor, with potential applications for deep UV optoelectronics, or as a building block of van der Waals heterostructures. The prerequisite to any sort of such applications is the knowledge of the electronic band structure, which we unveil using angle-resolved photoemission spectroscopy and rationalize with the help of density functional theory (DFT) calculations. We discover dispersing bands related to electronic delocalization within the top and bottom planes of the material, with two linear crossings reminiscent of those predicted in bilayer AA-stacked graphene, and semi-flat bands stemming from the chemical bridges between the two planes. This band structure is robust against exposure to air, and can be controlled by exposure to oxygen. We provide an experimental lower-estimate of the band gap size of 5 eV and predict a full gap of 7.36 eV using DFT calculations.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesInsufficient payload (model declined to judge)
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.006
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0010.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.031
GPT teacher head0.294
Teacher spread0.263 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one teacher head, not a consensus.

Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations9
Published2021
Admission routes1
Has abstractyes

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